N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine

C11H18N4 — CID 69427710

IUPACN-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine
SMILESCN(CC1CCNCC1)c1cccnn1
InChIInChI=1S/C11H18N4/c1-15(11-3-2-6-13-14-11)9-10-4-7-12-8-5-10/h2-3,6,10,12H,4-5,7-9H2,1H3
InChIKeyVBTRRRPHCZVWSZ-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.91
Rot. Bonds3

About N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine

N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine (PubChem CID 69427710) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine
PubChem CID69427710
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine
SMILESCN(CC1CCNCC1)c1cccnn1
InChIInChI=1S/C11H18N4/c1-15(11-3-2-6-13-14-11)9-10-4-7-12-8-5-10/h2-3,6,10,12H,4-5,7-9H2,1H3
InChIKeyVBTRRRPHCZVWSZ-UHFFFAOYSA-N
XLogP0.91
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine?
The IUPAC name of N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine (CID 69427710) is N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine?
The canonical SMILES for N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine is CN(CC1CCNCC1)c1cccnn1.
What is the InChIKey of N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine?
The InChIKey is VBTRRRPHCZVWSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-15(11-3-2-6-13-14-11)9-10-4-7-12-8-5-10/h2-3,6,10,12H,4-5,7-9H2,1H3.
What are the key properties of N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine?
N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine has a molecular weight of 206.29 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 69427710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).